[2-bromo-4-(2,3-difluorophenoxy)phenyl]hydrazine

C12H9BrF2N2O — CID 118138308

IUPAC[2-bromo-4-(2,3-difluorophenoxy)phenyl]hydrazine
SMILESNNc1ccc(Oc2cccc(F)c2F)cc1Br
InChIInChI=1S/C12H9BrF2N2O/c13-8-6-7(4-5-10(8)17-16)18-11-3-1-2-9(14)12(11)15/h1-6,17H,16H2
InChIKeyLAGGPAIXAKZQSX-UHFFFAOYSA-N
MW315.12 g/mol
LogP3.81
Rot. Bonds3

About [2-bromo-4-(2,3-difluorophenoxy)phenyl]hydrazine

[2-bromo-4-(2,3-difluorophenoxy)phenyl]hydrazine (PubChem CID 118138308) has the molecular formula C12H9BrF2N2O and a molecular weight of 315.12 g/mol. Its IUPAC name is [2-bromo-4-(2,3-difluorophenoxy)phenyl]hydrazine.

Molecular Properties

Compound Name[2-bromo-4-(2,3-difluorophenoxy)phenyl]hydrazine
PubChem CID118138308
Molecular FormulaC12H9BrF2N2O
Molecular Weight315.12 g/mol
Exact Mass313.99
IUPAC Name[2-bromo-4-(2,3-difluorophenoxy)phenyl]hydrazine
SMILESNNc1ccc(Oc2cccc(F)c2F)cc1Br
InChIInChI=1S/C12H9BrF2N2O/c13-8-6-7(4-5-10(8)17-16)18-11-3-1-2-9(14)12(11)15/h1-6,17H,16H2
InChIKeyLAGGPAIXAKZQSX-UHFFFAOYSA-N
XLogP3.81
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.12
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[2-bromo-4-(2,3-difluorophenoxy)phenyl]hydrazine;hydrochloride
CID 118138307
[4-(2,3-difluorophenoxy)-2-methoxyphenyl]hydrazine;hydrochloride
CID 118138355
4-(2,3-difluorophenoxy)benzene-1,2-diamine
CID 106748465
2-bromo-4-(2-fluorophenoxy)aniline
CID 138707019
[2-fluoro-4-(2-phosphanylphenoxy)phenyl]hydrazine
CID 146577721
[2-chloro-4-(2,3-difluorophenoxy)phenyl]methanamine
CID 55145340
4-(2,3-difluorophenoxy)benzenecarbothioamide
CID 63038333
[4-(2,3-difluorophenoxy)-6-(trifluoromethyl)pyrimidin-2-yl]hydrazine
CID 114567786
3-(2,3-difluorophenoxy)furan
CID 76539749
4-(2,3-difluorophenoxy)-2-methylbenzaldehyde
CID 63038344
[4-(2,3-difluorophenoxy)phenyl]boronic acid
CID 140785253
1-[2-(3-bromo-4-fluorophenoxy)-6-fluorophenyl]ethanone
CID 83235123

Frequently Asked Questions

What is the IUPAC name of [2-bromo-4-(2,3-difluorophenoxy)phenyl]hydrazine?
The IUPAC name of [2-bromo-4-(2,3-difluorophenoxy)phenyl]hydrazine (CID 118138308) is [2-bromo-4-(2,3-difluorophenoxy)phenyl]hydrazine.
What is the SMILES notation for [2-bromo-4-(2,3-difluorophenoxy)phenyl]hydrazine?
The canonical SMILES for [2-bromo-4-(2,3-difluorophenoxy)phenyl]hydrazine is NNc1ccc(Oc2cccc(F)c2F)cc1Br.
What is the InChIKey of [2-bromo-4-(2,3-difluorophenoxy)phenyl]hydrazine?
The InChIKey is LAGGPAIXAKZQSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9BrF2N2O/c13-8-6-7(4-5-10(8)17-16)18-11-3-1-2-9(14)12(11)15/h1-6,17H,16H2.
What are the key properties of [2-bromo-4-(2,3-difluorophenoxy)phenyl]hydrazine?
[2-bromo-4-(2,3-difluorophenoxy)phenyl]hydrazine has a molecular weight of 315.12 g/mol, XLogP of 3.81, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-bromo-4-(2,3-difluorophenoxy)phenyl]hydrazine is sourced from PubChem (CID 118138308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).